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102-97-6

102-97-6 Structure

102-97-6 Structure
IdentificationMore
[Name]

N-(1-Methylethyl)-benzenemethanamine
[CAS]

102-97-6
[Synonyms]

AURORA KA-7714
n-(1-methylethyl)-benzenemethanamine
N-BENZYLISOPROPYLAMINE
N-BENZYL-N-ISOPROPYLAMINE
N-ISOPROPYLBENZYLAMINE
Benzylamine, N-isopropyl-
Benzylisopropylamine
Isopropylbenzylamine
n-(1-methylethyl)-benzenemethanamin
N-ISOPROPYLBENZYLAMINE/N-BENZYLISOPROPYLAMINE
N-(b-Hydroxyethyl)pyrrolidine
N-Isopropylbenzenemethanamine
N-Isopropylphenylmethanamine
[EINECS(EC#)]

203-067-6
[Molecular Formula]

C10H15N
[MDL Number]

MFCD00008863
[Molecular Weight]

149.23
[MOL File]

102-97-6.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR VERY SLIGHTLY YELLOW TO YELLOW LIQUID
[Melting point ]

143°C (estimate)
[Boiling point ]

200 °C(lit.)
[density ]

0.892 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.502(lit.)
[Fp ]

190 °F
[storage temp. ]

Store below +30°C.
[solubility ]

Chloroform (Slightly), Ethy Acetate (Slightly), Methanol (Slightly)
[form ]

Oil
[pka]

9.77±0.19(Predicted)
[color ]

Colourless
[BRN ]

2638437
[InChI]

1S/C10H15N/c1-9(2)11-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3
[InChIKey]

LYBKPDDZTNUNNM-UHFFFAOYSA-N
[SMILES]

CC(C)NCc1ccccc1
[Uses]

Rust inhibitor; intermediate.
[CAS DataBase Reference]

102-97-6(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzenemethanamine, N-(1-methylethyl)-(102-97-6)
[EPA Substance Registry System]

102-97-6(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

2735
[WGK Germany ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29214980
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

N-(1-Methylethyl)-benzenemethanamine(102-97-6).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR VERY SLIGHTLY YELLOW TO YELLOW LIQUID
[Application]

N-Isopropylbenzylamine was used as ligand in the preparation and characterization of bis(cyclopentadienyl)magnesium. It was also used in the synthesis of N-benzylideneisopropylamine-N-oxide.
[Preparation]

N-Isopropylbenzylamine is an organic intermediate, which can be obtained by reduction of N-isopropylbenzamide or by reductive amination of benzylamine and acetone.
[General Description]

N-Isopropylbenzylamine forms amine adducts with magnesocene at ambient temperature in toluene.
[Cytotoxicity]

The toxicity of N-isopropylbenzylamine was evaluated in SH-SY5Y, PC12, and SN4741 cell lines. Cells were treated with 0.3–10 mM N-isopropylbenzylamine for 24 hours, and cell viability was measured using MTT assay. N-isopropylbenzylamine concentration-dependently reduced cell viability in these cells. The IC50 values of N-isopropylbenzylamine on cell viability were 3.47, 1.49, and 3.21 mM for SH-SY5Y cells, PC12 cells, and SN4741 cells, respectively. N-isopropylbenzylamine produced toxicity in cell lines that model neurons. Moreover, the activation of nNOS and the production of intracellular NO might be involved in N-isopropylbenzylamine-induced toxicity in SN4741 cells[1].
[References]

[1] Peng Xu . “N-isopropylbenzylamine, a methamphetamine mimics, produces toxicity via increasing nitric oxide in vitro.” Toxicology 480 (2022): Article 153337.
Spectrum DetailBack Directory
[Spectrum Detail]

N-Isopropylbenzylamine(102-97-6)MS
N-Isopropylbenzylamine(102-97-6)1HNMR
N-Isopropylbenzylamine(102-97-6)13CNMR
N-Isopropylbenzylamine(102-97-6)IR1
N-Isopropylbenzylamine(102-97-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

N-Isopropylbenzylamine, 97%(102-97-6)
[Alfa Aesar]

N-Isopropylbenzylamine, 97%(102-97-6)
[Sigma Aldrich]

102-97-6(sigmaaldrich)
[TCI AMERICA]

N-Isopropylbenzylamine,>98.0%(GC)(T)(102-97-6)
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